5-(2-adamantylamino)-1,3-dimethyl-6-nitro-benzimidazol-2-one

Systemtic Name: 5-(2-adamantylamino)-1,3-dimethyl-6-nitro-benzimidazol-2-one Openeye Name: 5-(2-adamantylamino)-1,3-dimethyl-6-nitro-benzimidazol-2-one CAS Name: 5-(2-adamantylamino)-1,3-dimethyl-6-nitro-2-benzimidazolone IUPAC Name: 5-(2-adamantylamino)-1,3-dimethyl-6-nitrobenzimidazol-2-one Traditional Name: 5-(2-adamantylamino)-1,3-dimethyl-6-nitro-benzimidazol-2-one Formula: C19H24N4O3 MolecularWeight: 356.41886

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C(C=C2N(C1=O)C)[N+](=O)[O-])NC3C4CC5CC(C4)CC3C5

Isomeric SMILES

CN1C2=CC(=C(C=C2N(C1=O)C)[N+](=O)[O-])NC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C19H24N4O3/c1-21-16-8-14(15(23(25)26)9-17(16)22(2)19(21)24)20-18-12-4-10-3-11(6-12)7-13(18)5-10/h8-13,18,20H,3-7H2,1-2H3